CFam Chemical Families Database
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You are searching for "CFAMM00121141" in compound.

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CFAM Mol ID CFAMM00121141
Family CFFAD1057 Rotenone family
Superfamily CFSAD887 Rotenone Superfamily
Class CFCAD776 Class 776
External ID HMDB31895 External Source HMDB
PubChem CID 22834921 Functional Category Human Metabolite
Molecule Name Castacrenin G
IUPAC Name 7,8,9,12,13,14,25,26,27,30,31,32,35,40,46,47-hexadecahydroxy-3,18,21,38,49,55,58,62-octaoxatetradecacyclo[^{34,54}.2^{41,44}.0^{2,20}.0^{5,10}.0^{11,16}.0^{23,28}.0^{33,57}.0^{37,53}.0^{39,52}.0^{42,51}.0^{43,48}.0^{37,60}]dohexaconta-5(10),6,8,11(16),12,14,23,25,27,29,31,33(57),34,39(52),40,42(51),43,45,47-nonadecaen-4,17,22,36,50,56,59,61-octone
InChi InChI=1S/C54H28O32/c55-10-1-6-15(32(63)28(10)59)16-7(2-11(56)29(60)33(16)64)49(74)81-40-14(5-79-47(6)72)80-48(73)8-3-12(57)30(61)34(65)17(8)19-22-20(36(67)38(69)35(19)66)24-27-53(78)84-44(45(40)85-51(22)76)26-25-23-21-18-9(4-13(58)31(62)41(18)83-52(23)77)50(75)82-42(21)39(70)43(25)86-54(26,27)46(71)37(24)68/h1-4,14,26-27,40,44-45,55-70H,5H2
Formula C54H28O32 Molecular Weight 1188.78
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Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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