Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 13745
- Core Entity Id
- 18448
- Source Entity Count
- 1
- Preferred Name
- Carbobenzoxyhydrazide
- Name En
- Pubchem Id
- 79242
- Smiles Canonical
- C1=CC=C(C=C1)COC(=O)NN
- Molecular Formula
- C8H10N2O2
- Molecular Weight
- 166.1800
- Inchikey
- RXUBZLMIGSAPEJ-UHFFFAOYSA-N
- Inchi
- InChI=1S/C8H10N2O2/c9-10-8(11)12-6-7-4-2-1-3-5-7/h1-5H,6,9H2,(H,10,11)
- Isomeric Smiles
- C1=CC=C(C=C1)COC(=O)NN
- Cas Id
- Ob Score
- Mol Logp
- 0.7865
- Num H Donors
- 2
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 2
- Drug Likeness
- 0.3880
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Carbobenzoxyhydrazide
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Carbobenzoxyhydrazide
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
carbobenzoxyhydrazide
Role
preferred
Source
TCMBank
Preferred
Yes
Name
((Benzyloxy)carbonyl)hydrazine
Role
alias
Source
itcmdb_public
Preferred
No
Name
((Benzyloxy)carbonyl)hydrazine
Role
alias
Source
HERB_v2
Preferred
No
Name
5331-43-1
Role
alias
Source
itcmdb_public
Preferred
No
Name
5331-43-1
Role
alias
Source
HERB_v2
Preferred
No
Name
Benzyl carbazate
Role
alias
Source
HERB_v2
Preferred
No
Name
Benzyl carbazate
Role
alias
Source
itcmdb_public
Preferred
No
Name
Benzyl hydrazinecarboxylate
Role
alias
Source
itcmdb_public
Preferred
No
Name
Benzyl hydrazinecarboxylate
Role
alias
Source
HERB_v2
Preferred
No
Name
Benzyloxycarbonyl hydrazide
Role
alias
Source
HERB_v2
Preferred
No
Name
Benzyloxycarbonyl hydrazide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Carbazic acid, benzyl ester
Role
alias
Source
itcmdb_public
Preferred
No
Name
Carbazic acid, benzyl ester
Role
alias
Source
HERB_v2
Preferred
No
Name
Hydrazinecarboxylic acid, phenylmethyl ester
Role
alias
Source
itcmdb_public
Preferred
No
Name
Hydrazinecarboxylic acid, phenylmethyl ester
Role
alias
Source
HERB_v2
Preferred
No
Name
benzyl N-aminocarbamate
Role
alias
Source
itcmdb_public
Preferred
No
Name
benzyl N-aminocarbamate
Role
alias
Source
HERB_v2
Preferred
No
Aliases
Additional names normalized into the restored final schema.
((Benzyloxy)carbonyl)hydrazine5331-43-1Benzyl carbazateBenzyl hydrazinecarboxylateBenzyloxycarbonyl hydrazideCarbazic acid, benzyl esterHydrazinecarboxylic acid, phenylmethyl esterbenzyl N-aminocarbamate
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN019711
Tcmid
36815
Pub Chem
79242
Tcmbank
TCMBANKIN014008
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C8H10N2O2/c9-10-8(11)12-6-7-4-2-1-3-5-7/h1-5H,6,9H2,(H,10,11)
Mol Wt
166.18
Smiles
C1=CC=C(C=C1)COC(=O)NN
Mol Log P
0.7865000000000002
In Ch Ikey
RXUBZLMIGSAPEJ-UHFFFAOYSA-N
Num Hdonors
2
Drug Likeness
0.388
Num Hacceptors
3
Isomeric Smiles
C1=CC=C(C=C1)COC(=O)NN
Canonical Smiles
C1=CC=C(C=C1)COC(=O)NN
Herb Alias Names
Benzyl carbazate5331-43-1Benzyl hydrazinecarboxylateHydrazinecarboxylic acid, phenylmethyl esterCarbazic acid, benzyl esterBenzyloxycarbonyl hydrazidebenzyl N-aminocarbamateBenzylcarbazate((Benzyloxy)carbonyl)hydrazine
Molecular Weight
166.18 g/mol
Molecular Formula
C8H10N2O2
Molecular Formula
C8H10N2O2
Num Rotatable Bonds
2