Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 8Ingredient: 1Target: 9Links: 17
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 14911
- Core Entity Id
- 19737
- Source Entity Count
- 1
- Preferred Name
- Clovene
- Name En
- Pubchem Id
- 10102
- Smiles Canonical
- CC1(C=CC23C1CCC(C2)(CCC3)C)C
- Molecular Formula
- C15H24
- Molecular Weight
- 204.3570
- Inchikey
- MKZIRHIVARSBHI-AEGPPILISA-N
- Inchi
- InChI=1S/C15H24/c1-13(2)9-10-15-7-4-6-14(3,11-15)8-5-12(13)15/h9-10,12H,4-8,11H2,1-3H3/t12-,14-,15+/m0/s1
- Isomeric Smiles
- C[C@@]12CCC[C@]3(C1)C=CC([C@@H]3CC2)(C)C
- Cas Id
- 469-92-1
- Ob Score
- 46.4940
- Mol Logp
- 4.5591
- Num H Donors
- 0
- Num H Acceptors
- 0
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.5070
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
CLOVENE
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Clovene
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Clovene
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Clovene
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Clovene
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
(-)-Clovene
Role
alias
Source
itcmdb_public
Preferred
No
Name
(-)-Clovene
Role
alias
Source
HERB_v2
Preferred
No
Name
(1S,5S,8S)-4,4,8-Trimethyltricyclo[6.3.1.01,5]dodec-2-ene
Role
alias
Source
itcmdb_public
Preferred
No
Name
(1S,5S,8S)-4,4,8-Trimethyltricyclo[6.3.1.01,5]dodec-2-ene
Role
alias
Source
HERB_v2
Preferred
No
Name
1,1,7-Trimethyl-1,4,5,6,7,8,9,9a-octahydro-3a,7-methanocyclopenta[8]annulene
Role
alias
Source
itcmdb_public
Preferred
No
Name
1,1,7-Trimethyl-1,4,5,6,7,8,9,9a-octahydro-3a,7-methanocyclopenta[8]annulene
Role
alias
Source
HERB_v2
Preferred
No
Name
469-92-1
Role
alias
Source
HERB_v2
Preferred
No
Name
469-92-1
Role
alias
Source
TCMBank
Preferred
No
Name
469-92-1
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXSID10963697
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID10963697
Role
alias
Source
itcmdb_public
Preferred
No
Name
clovene
Role
alias
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
(-)-Clovene(1S,5S,8S)-4,4,8-Trimethyltricyclo[6.3.1.01,5]dodec-2-ene1,1,7-Trimethyl-1,4,5,6,7,8,9,9a-octahydro-3a,7-methanocyclopenta[8]annulene469-92-1DTXSID10963697
Cross References
Trusted external identifiers retained for this final record.
Cas
469-92-1
Herb
HBIN021147
Npass
NPC21144
Tcmid
3848
Tcmsp
MOL013269
Sym Map
SMIT13947
Pub Chem
1010211229486521210
Tcmbank
TCMBANKIN000994
Etcm Ingredient
Clovene
Itcmdb Generated
ITX-INGREDIENT-A3FAD356088A
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C15H24/c1-13(2)9-10-15-7-4-6-14(3,11-15)8-5-12(13)15/h9-10,12H,4-8,11H2,1-3H3/t12-,14-,15+/m0/s1
Mol Wt
204.357
Cas Id
469-92-1
Smiles
CC1(C=CC23C1CCC(C2)(CCC3)C)C
Mol Log P
4.559100000000003
Version
v1,v2
In Ch Ikey
MKZIRHIVARSBHI-AEGPPILISA-N
Ob Score
46.49446.4943306746.494331
Suppress
0
Num Hdonors
0
Drug Likeness
0.507
Num Hacceptors
0
Isomeric Smiles
C[C@@]12CCC[C@]3(C1)C=CC([C@@H]3CC2)(C)C
Molecule Weight
204.39
Canonical Smiles
CC1(C=CC23C1CCC(C2)(CCC3)C)C
Herb Alias Names
469-92-1(1S,5S,8S)-4,4,8-Trimethyltricyclo[6.3.1.01,5]dodec-2-ene(-)-CloveneDTXSID109636971,1,7-Trimethyl-1,4,5,6,7,8,9,9a-octahydro-3a,7-methanocyclopenta[8]annulene
Molecular Weight
204.190
Molecular Weight
204.35
Molecular Formula
C15H24
Molecular Formula
C15H24
Molecular Formula
C15H24
Num Rotatable Bonds
0
Fda Maximum Daily Dose (Fdamdd)
0.570
Quantitative Estimate Of Drug Likeness（Qed）
0.507