IngredientID 31789

Rhamnazin-3-o-beta-d-glucoside

C23H24O12

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Relationship Network

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Herb: 3Ingredient: 1Links: 3
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
31789
Core Entity Id
38525
Source Entity Count
1
Preferred Name
Rhamnazin-3-o-beta-d-glucoside
Name En
Pubchem Id
5491385
Smiles Canonical
COC1=CC(=C2C(=C1)OC(=C(C2=O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)OC)O
Molecular Formula
C23H24O12
Molecular Weight
492.4000
Inchikey
NULDUMWEBSEHPR-LNNZMUSMSA-N
Inchi
InChI=1S/C23H24O12/c1-31-10-6-12(26)16-14(7-10)33-21(9-3-4-11(25)13(5-9)32-2)22(18(16)28)35-23-20(30)19(29)17(27)15(8-24)34-23/h3-7,15,17,19-20,23-27,29-30H,8H2,1-2H3/t15-,17-,19+,20-,23+/m1/s1
Isomeric Smiles
Cas Id
Ob Score
Mol Logp
1.0000
Num H Donors
6
Num H Acceptors
12
Num Rotatable Bonds
6
Drug Likeness
Polar Surface Area
185.0000
Molecular Volume
Alogp

Names

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

Name
Rhamnazin-3-o-beta-d-glucoside
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Rhamnazin-3-o-beta-d-glucoside
Role
preferred
Source
itcmdb_public
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Herb
HBIN042153
Tcmid
18660
Sym Map
SMIT17441