Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 5Ingredient: 1Links: 5
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 60765
- Core Entity Id
- 107783
- Source Entity Count
- 1
- Preferred Name
- Poriferast-5-En-3Beta-Ol
- Name En
- Pubchem Id
- 457801
- Smiles Canonical
- CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
- Molecular Formula
- C29H50O
- Molecular Weight
- 414.7900
- Inchikey
- KZJWDPNRJALLNS-FBZNIEFRSA-N
- Inchi
- InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21+,23+,24+,25-,26+,27+,28+,29-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- 36.9139
- Mol Logp
- 9.3000
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 6
- Drug Likeness
- Polar Surface Area
- 20.2000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Poriferast-5-En-3Beta-Ol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Version
v1,v2
Ob Score
36.91390583
Suppress
0
Molecule Weight
414.79