Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Ingredient: 1Target: 12Links: 12
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 37746
- Core Entity Id
- 58553
- Source Entity Count
- 1
- Preferred Name
- 11-hydroxynoracronycine
- Name En
- Pubchem Id
- 5378702
- Smiles Canonical
- CC1(C=CC2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4O)C)O)C
- Molecular Formula
- C19H17NO4
- Molecular Weight
- 323.3480
- Inchikey
- JZQDCDLYNFZBIG-UHFFFAOYSA-N
- Inchi
- InChI=1S/C19H17NO4/c1-19(2)8-7-10-14(24-19)9-13(22)15-17(10)20(3)16-11(18(15)23)5-4-6-12(16)21/h4-9,21-22H,1-3H3
- Isomeric Smiles
- CC1(C=CC2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4O)C)O)C
- Cas Id
- 27067-70-5
- Ob Score
- 54.2425
- Mol Logp
- 3.2871
- Num H Donors
- 2
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.6230
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
11-Hydroxynoracronycine
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
11-Hydroxynoracronycine
Role
preferred
Source
TCMBank
Preferred
Yes
Name
11-Hydroxynoracronycine
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
11-hydroxynoracronycine
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
11-hydroxynoracronycine
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
11-Hydroxy-O-demethylacronine
Role
alias
Source
TCMBank
Preferred
No
Name
11-Hydroxy-O-demethylacronine
Role
alias
Source
HERB_v2
Preferred
No
Name
11-Hydroxy-O-demethylacronine
Role
alias
Source
itcmdb_public
Preferred
No
Name
27067-70-5
Role
alias
Source
TCMBank
Preferred
No
Name
27067-70-5
Role
alias
Source
HERB_v2
Preferred
No
Name
27067-70-5
Role
alias
Source
itcmdb_public
Preferred
No
Name
3,12-Dihydro-6,11-dihydroxy-3,312-trimethyl-7H-pyrano(2,3-c)acridin-7-one
Role
alias
Source
TCMBank
Preferred
No
Name
5-HYDROXYNORACRONYCIN
Role
alias
Source
HERB_v2
Preferred
No
Name
5-HYDROXYNORACRONYCIN
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-Hydroxyacronine
Role
alias
Source
HERB_v2
Preferred
No
Name
5-Hydroxyacronine
Role
alias
Source
itcmdb_public
Preferred
No
Name
54E45U4Q3N
Role
alias
Source
HERB_v2
Preferred
No
Name
54E45U4Q3N
Role
alias
Source
itcmdb_public
Preferred
No
Name
6,11-dihydroxy-3,3,12-trimethyl-7-pyrano[6,5-c]acridinone
Role
alias
Source
TCMBank
Preferred
No
Name
6,11-dihydroxy-3,3,12-trimethyl-pyrano[6,5-c]acridin-7-one
Role
alias
Source
TCMBank
Preferred
No
Name
7H-Pyrano(2,3-c)acridin-7-one, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl- (8CI)(9CI)
Role
alias
Source
TCMBank
Preferred
No
Name
7H-Pyrano[2,3-c]acridin-7-one, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl-
Role
alias
Source
TCMBank
Preferred
No
Name
AIDS-161807
Role
alias
Source
TCMBank
Preferred
No
Name
Alkaloid A from Atalantia ceylanica
Role
alias
Source
HERB_v2
Preferred
No
Name
Alkaloid A, from Atalantia ceylanica
Role
alias
Source
TCMBank
Preferred
No
Name
Alkaloid A, from Atalantia ceylanica
Role
alias
Source
itcmdb_public
Preferred
No
Name
NSC 162687
Role
alias
Source
HERB_v2
Preferred
No
Name
NSC-162687
Role
alias
Source
itcmdb_public
Preferred
No
Name
NSC162687
Role
alias
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
11-Hydroxy-O-demethylacronine27067-70-53,12-Dihydro-6,11-dihydroxy-3,312-trimethyl-7H-pyrano(2,3-c)acridin-7-one5-HYDROXYNORACRONYCIN5-Hydroxyacronine54E45U4Q3N6,11-dihydroxy-3,3,12-trimethyl-7-pyrano[6,5-c]acridinone6,11-dihydroxy-3,3,12-trimethyl-pyrano[6,5-c]acridin-7-one7H-Pyrano(2,3-c)acridin-7-one, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl- (8CI)(9CI)7H-Pyrano[2,3-c]acridin-7-one, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl-AIDS-161807Alkaloid A from Atalantia ceylanicaAlkaloid A, from Atalantia ceylanicaNSC 162687NSC-162687NSC162687
Cross References
Trusted external identifiers retained for this final record.
Cas
27067-70-5
Herb
HBIN000448
Npass
NPC305542
Tcmsp
MOL008792
Sym Map
SMIT10015
Pub Chem
5378702
Tcmbank
TCMBANKIN032114
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C19H17NO4/c1-19(2)8-7-10-14(24-19)9-13(22)15-17(10)20(3)16-11(18(15)23)5-4-6-12(16)21/h4-9,21-22H,1-3H3
Mol Wt
323.3480000000001
Cas Id
27067-70-5
Smiles
CC1(C=CC2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4O)C)O)C
Mol Log P
3.287100000000001
Version
v1,v2
In Ch Ikey
JZQDCDLYNFZBIG-UHFFFAOYSA-N
Ob Score
54.2425377654.24253854.243
Suppress
0
Num Hdonors
2
Drug Likeness
0.623
Num Hacceptors
5
Isomeric Smiles
CC1(C=CC2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4O)C)O)C
Molecule Weight
323.37
Canonical Smiles
CC1(C=CC2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4O)C)O)C
Herb Alias Names
27067-70-511-Hydroxy-O-demethylacronineAlkaloid A from Atalantia ceylanica5-Hydroxyacronine54E45U4Q3NAlkaloid A, from Atalantia ceylanicaNSC 162687NSC-1626875-HYDROXYNORACRONYCIN
Molecular Weight
323.3 g/mol
Molecular Formula
C19H17NO4
Molecular Formula
C19H17NO4
Num Rotatable Bonds
0