Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Target: 9Links: 11
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 17832
- Core Entity Id
- 22993
- Source Entity Count
- 1
- Preferred Name
- Eburnamonine
- Name En
- Pubchem Id
- 6973664
- Smiles Canonical
- CCC12CCCN3C1C4=C(CC3)C5=CC=CC=C5N4C(=O)C2
- Molecular Formula
- C19H22N2O
- Molecular Weight
- 294.3980
- Inchikey
- WYJAPUKIYAZSEM-RBUKOAKNSA-N
- Inchi
- InChI=1S/C19H22N2O/c1-2-19-9-5-10-20-11-8-14-13-6-3-4-7-15(13)21(16(22)12-19)17(14)18(19)20/h3-4,6-7,18H,2,5,8-12H2,1H3/t18-,19+/m0/s1
- Isomeric Smiles
- CC[C@]12CCCN3[C@H]1C4=C(CC3)C5=CC=CC=C5N4C(=O)C2
- Cas Id
- Ob Score
- Mol Logp
- 3.7746
- Num H Donors
- 0
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 1
- Drug Likeness
- 0.8000
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Eburnamonine
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Eburnamonine
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Eburnamonine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
eburnamonine
Role
preferred
Source
TCMBank
Preferred
Yes
Name
(+)-Eburnamonine
Role
alias
Source
itcmdb_public
Preferred
No
Name
(+)-Eburnamonine
Role
alias
Source
HERB_v2
Preferred
No
Name
(+)-Vincamone
Role
alias
Source
HERB_v2
Preferred
No
Name
(+)-Vincamone
Role
alias
Source
itcmdb_public
Preferred
No
Name
(+)-cis-Eburnamonine
Role
alias
Source
itcmdb_public
Preferred
No
Name
(+)-cis-Eburnamonine
Role
alias
Source
HERB_v2
Preferred
No
Name
474-00-0
Role
alias
Source
itcmdb_public
Preferred
No
Name
474-00-0
Role
alias
Source
HERB_v2
Preferred
No
Name
EINECS 207-476-0
Role
alias
Source
HERB_v2
Preferred
No
Name
EINECS 207-476-0
Role
alias
Source
itcmdb_public
Preferred
No
Name
Eburnamenin-14(15H)-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
Eburnamenin-14(15H)-one
Role
alias
Source
HERB_v2
Preferred
No
Name
NPD9S131ZU
Role
alias
Source
itcmdb_public
Preferred
No
Name
NPD9S131ZU
Role
alias
Source
HERB_v2
Preferred
No
Name
UNII-NPD9S131ZU
Role
alias
Source
HERB_v2
Preferred
No
Name
UNII-NPD9S131ZU
Role
alias
Source
itcmdb_public
Preferred
No
Name
d-Eburnamonine
Role
alias
Source
HERB_v2
Preferred
No
Name
d-Eburnamonine
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
(+)-Eburnamonine(+)-Vincamone(+)-cis-Eburnamonine474-00-0EINECS 207-476-0Eburnamenin-14(15H)-oneNPD9S131ZUUNII-NPD9S131ZUd-Eburnamonine
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN024780
Npass
NPC228710
Tcmid
6676
Pub Chem
697366492112
Tcmbank
TCMBANKIN035475
Etcm Ingredient
Eburnamonine
Itcmdb Generated
ITX-INGREDIENT-6E38900422FC
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C19H22N2O/c1-2-19-9-5-10-20-11-8-14-13-6-3-4-7-15(13)21(16(22)12-19)17(14)18(19)20/h3-4,6-7,18H,2,5,8-12H2,1H3/t18-,19+/m0/s1
Mol Wt
294.3980000000001
Smiles
CCC12CCCN3C1C4=C(CC3)C5=CC=CC=C5N4C(=O)C2
Mol Log P
3.774600000000003
In Ch Ikey
WYJAPUKIYAZSEM-RBUKOAKNSA-N
Num Hdonors
0
Drug Likeness
0.8
Num Hacceptors
3
Isomeric Smiles
CC[C@]12CCCN3[C@H]1C4=C(CC3)C5=CC=CC=C5N4C(=O)C2
Canonical Smiles
CCC12CCCN3C1C4=C(CC3)C5=CC=CC=C5N4C(=O)C2
Herb Alias Names
Eburnamenin-14(15H)-one474-00-0d-Eburnamonine(+)-cis-Eburnamonine(+)-Eburnamonine(+)-VincamoneUNII-NPD9S131ZUEINECS 207-476-0NPD9S131ZU
Molecular Weight
294.170
Molecular Weight
294.4 g/mol
Molecular Formula
C19H22N2O
Molecular Formula
C19H22N2O
Molecular Formula
C19H22N2O
Num Rotatable Bonds
1
Fda Maximum Daily Dose (Fdamdd)
0.978
Quantitative Estimate Of Drug Likeness（Qed）
0.800