IngredientID 18148

Ent-kauran-16alpha,17-diol

C20H34O2

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Relationship Network

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Herb: 4Ingredient: 1Links: 4
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
18148
Core Entity Id
23347
Source Entity Count
1
Preferred Name
Ent-kauran-16alpha,17-diol
Name En
Pubchem Id
13816757
Smiles Canonical
CC1(CCCC2(C1CCC34C2CCC(C3)C(C4)(CO)O)C)C
Molecular Formula
C20H34O2
Molecular Weight
306.5000
Inchikey
LCYWCTWYVKIBSA-ZYLYKIMZSA-N
Inchi
InChI=1S/C20H34O2/c1-17(2)8-4-9-18(3)15(17)7-10-19-11-14(5-6-16(18)19)20(22,12-19)13-21/h14-16,21-22H,4-13H2,1-3H3/t14-,15+,16-,18+,19-,20-/m0/s1
Isomeric Smiles
Cas Id
Ob Score
Mol Logp
4.9000
Num H Donors
2
Num H Acceptors
2
Num Rotatable Bonds
1
Drug Likeness
Polar Surface Area
40.5000
Molecular Volume
Alogp

Names

Preferred names, aliases, and source labels retained in the final schema.

Name
Ent-kauran-16alpha,17-diol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Ent-kauran-16alpha,17-diol
Role
preferred
Source
itcmdb_public
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Herb
HBIN025196
Tcmid
12164
Sym Map
SMIT16184

Attributes

Merged source attributes and domain-specific metadata.

Molecular Formula
C20H34O2