Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 2Links: 4
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 18637
- Core Entity Id
- 23892
- Source Entity Count
- 1
- Preferred Name
- Eseridine
- Name En
- Pubchem Id
- 65719
- Smiles Canonical
- CC12CCN(OC1N(C3=C2C=C(C=C3)OC(=O)NC)C)C
- Molecular Formula
- C15H21N3O3
- Molecular Weight
- 291.3510
- Inchikey
- CNBHDDBNEKKMJH-ZFWWWQNUSA-N
- Inchi
- InChI=1S/C15H21N3O3/c1-15-7-8-17(3)21-13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15-/m0/s1
- Isomeric Smiles
- C[C@@]12CCN(O[C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C
- Cas Id
- Ob Score
- Mol Logp
- 1.7055
- Num H Donors
- 1
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 1
- Drug Likeness
- 0.8530
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Eseridine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Eseridine
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Eseridine
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
eseridine
Role
preferred
Source
TCMBank
Preferred
Yes
Name
25573-43-7
Role
alias
Source
itcmdb_public
Preferred
No
Name
25573-43-7
Role
alias
Source
HERB_v2
Preferred
No
Name
Eseridina [Spanish]
Role
alias
Source
HERB_v2
Preferred
No
Name
Eseridina [Spanish]
Role
alias
Source
itcmdb_public
Preferred
No
Name
Eseridine [INN]
Role
alias
Source
itcmdb_public
Preferred
No
Name
Eseridine [INN]
Role
alias
Source
HERB_v2
Preferred
No
Name
Eseridinum [Latin]
Role
alias
Source
itcmdb_public
Preferred
No
Name
Eseridinum [Latin]
Role
alias
Source
HERB_v2
Preferred
No
Name
Eserine aminoxide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Eserine aminoxide
Role
alias
Source
HERB_v2
Preferred
No
Name
Eserine oxide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Eserine oxide
Role
alias
Source
HERB_v2
Preferred
No
Name
Geneserine
Role
alias
Source
HERB_v2
Preferred
No
Name
Geneserine
Role
alias
Source
itcmdb_public
Preferred
No
Name
NSC-340071
Role
alias
Source
HERB_v2
Preferred
No
Name
NSC-340071
Role
alias
Source
itcmdb_public
Preferred
No
Name
[(4aS,9aS)-2,4a,9-trimethyl-4,9a-dihydro-3H-oxazino[6,5-b]indol-6-yl] N-methylcarbamate
Role
alias
Source
HERB_v2
Preferred
No
Name
[(4aS,9aS)-2,4a,9-trimethyl-4,9a-dihydro-3H-oxazino[6,5-b]indol-6-yl] N-methylcarbamate
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
25573-43-7Eseridina [Spanish]Eseridine [INN]Eseridinum [Latin]Eserine aminoxideEserine oxideGeneserineNSC-340071[(4aS,9aS)-2,4a,9-trimethyl-4,9a-dihydro-3H-oxazino[6,5-b]indol-6-yl] N-methylcarbamate
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN025805
Tcmid
7379
Pub Chem
65719
Tcmbank
TCMBANKIN036587
Etcm Ingredient
Eseridine
Itcmdb Generated
ITX-INGREDIENT-BDB7BBC985A6
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C15H21N3O3/c1-15-7-8-17(3)21-13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15-/m0/s1
Mol Wt
291.3510000000001
Smiles
CC12CCN(OC1N(C3=C2C=C(C=C3)OC(=O)NC)C)C
Mol Log P
1.7055
In Ch Ikey
CNBHDDBNEKKMJH-ZFWWWQNUSA-N
Num Hdonors
1
Drug Likeness
0.853
Num Hacceptors
5
Isomeric Smiles
C[C@@]12CCN(O[C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C
Canonical Smiles
CC12CCN(OC1N(C3=C2C=C(C=C3)OC(=O)NC)C)C
Herb Alias Names
GeneserineEserine aminoxideEserine oxide25573-43-7Eseridine [INN]Eseridinum [Latin]Eseridina [Spanish]NSC-340071[(4aS,9aS)-2,4a,9-trimethyl-4,9a-dihydro-3H-oxazino[6,5-b]indol-6-yl] N-methylcarbamate
Molecular Weight
291.160
Molecular Weight
291.35 g/mol
Molecular Formula
C15H21N3O3
Molecular Formula
C15H21N3O3
Molecular Formula
C15H21N3O3
Num Rotatable Bonds
1
Fda Maximum Daily Dose (Fdamdd)
0.773
Quantitative Estimate Of Drug Likeness（Qed）
0.853