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

Details

Stereochemistry ABSOLUTE
Molecular Formula C59H89N15O19
Molecular Weight 1312.4271
Optical Activity UNSPECIFIED
Defined Stereocenters 12 / 12
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NO_NAME

SMILES

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)NCC(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N5CCC[C@H]5C(=O)N[C@@H](C)C(O)=O

InChI

InChIKey=POQYLXDICPLXBV-OVARNJHUSA-N
InChI=1S/C59H89N15O19/c1-30(2)23-37(69-53(86)39(28-75)67-46(79)26-63-51(84)38(24-35-15-17-36(77)18-16-35)68-49(82)32(4)64-52(85)40(29-76)70-48(81)31(3)60)50(83)62-25-45(78)61-27-47(80)71-19-7-11-41(71)54(87)65-33(5)56(89)73-21-9-13-43(73)58(91)74-22-10-14-44(74)57(90)72-20-8-12-42(72)55(88)66-34(6)59(92)93/h15-18,30-34,37-44,75-77H,7-14,19-29,60H2,1-6H3,(H,61,78)(H,62,83)(H,63,84)(H,64,85)(H,65,87)(H,66,88)(H,67,79)(H,68,82)(H,69,86)(H,70,81)(H,92,93)/t31-,32-,33-,34-,37-,38-,39-,40-,41-,42-,43-,44-/m0/s1

HIDE SMILES / InChI

Approval Year