Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Links: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 19505
- Core Entity Id
- 24862
- Source Entity Count
- 1
- Preferred Name
- Furanoeremophilane-6beta,10beta-diol
- Name En
- Pubchem Id
- 5317427
- Smiles Canonical
- CC1CCCC2(C1(C(C3=C(C2)OC=C3C)O)C)O
- Molecular Formula
- C15H22O3
- Molecular Weight
- 250.3380
- Inchikey
- NEEFWFDZIRSXDP-PUPMMZHASA-N
- Inchi
- InChI=1S/C15H22O3/c1-9-8-18-11-7-15(17)6-4-5-10(2)14(15,3)13(16)12(9)11/h8,10,13,16-17H,4-7H2,1-3H3/t10-,13+,14-,15-/m0/s1
- Isomeric Smiles
- C[C@H]1CCC[C@]2([C@@]1([C@@H](C3=C(C2)OC=C3C)O)C)O
- Cas Id
- Ob Score
- Mol Logp
- 2.7349
- Num H Donors
- 2
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.7440
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Furanoeremophilane-6-beta,10-beta-diol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Furanoeremophilane-6beta,10beta-diol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Furanoeremophilane-6beta,10beta-diol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
furanoeremophilane-6beta,10beta-diol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
furanoeremophilane-6β,10β-diol
Role
alias
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
Furanoeremophilane-6-beta,10-beta-diolfuranoeremophilane-6β,10β-diol
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN026861
Npass
NPC58435
Tcmid
309858016
Pub Chem
5317427
Tcmbank
TCMBANKIN008727
Etcm Ingredient
Furanoeremophilane-6-beta,10-beta-diol
Itcmdb Generated
ITX-INGREDIENT-AA20D0EAC480
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C15H22O3/c1-9-8-18-11-7-15(17)6-4-5-10(2)14(15,3)13(16)12(9)11/h8,10,13,16-17H,4-7H2,1-3H3/t10-,13+,14-,15-/m0/s1
Mol Wt
250.338
Smiles
CC1CCCC2(C1(C(C3=C(C2)OC=C3C)O)C)O
Mol Log P
2.734920000000001
In Ch Ikey
NEEFWFDZIRSXDP-PUPMMZHASA-N
Num Hdonors
2
Drug Likeness
0.744
Num Hacceptors
3
Isomeric Smiles
C[C@H]1CCC[C@]2([C@@]1([C@@H](C3=C(C2)OC=C3C)O)C)O
Canonical Smiles
CC1CCCC2(C1(C(C3=C(C2)OC=C3C)O)C)O
Molecular Weight
250.160
Molecular Formula
C15H22O3
Molecular Formula
C15H22O3
Molecular Formula
C15H22O3
Num Rotatable Bonds
0
Fda Maximum Daily Dose (Fdamdd)
0.938
Quantitative Estimate Of Drug Likeness（Qed）
0.744