U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C43H76N12O15
Molecular Weight 1001.1349
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NO_NAME

SMILES

CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)O)C(O)=O

InChI

InChIKey=JBVSZAIPEUJXKX-FDFXPSBOSA-N
InChI=1S/C43H76N12O15/c1-20(2)17-28(52-35(62)24(44)9-8-16-48-43(46)47)40(67)53-29(18-21(3)4)39(66)50-25(10-13-31(45)57)36(63)49-27(12-15-33(60)61)38(65)55-34(23(7)56)41(68)51-26(11-14-32(58)59)37(64)54-30(42(69)70)19-22(5)6/h20-30,34,56H,8-19,44H2,1-7H3,(H2,45,57)(H,49,63)(H,50,66)(H,51,68)(H,52,62)(H,53,67)(H,54,64)(H,55,65)(H,58,59)(H,60,61)(H,69,70)(H4,46,47,48)/t23-,24+,25+,26+,27+,28+,29+,30+,34+/m1/s1

HIDE SMILES / InChI

Approval Year