4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[2-carboxy-2-(3-thien...
C15H16N2O6S2.2Na
4697-14-7 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  27 28 0 0 0
M  V30 BEGIN ATOM
M  V30 1 N 7.1345 6.1434 0.0 0
M  V30 2 C 8.4681 5.3734 0.0 0
M  V30 3 C 9.8018 6.1434 0.0 0 CFG=3
M  V30 4 O 8.4681 3.8334 0.0 0
M  V30 5 C 9.8018 7.6834 0.0 0
M  V30 6 O 11.1354 8.4535 0.0 0
M  V30 7 O 8.4681 8.4535 0.0 0
M  V30 8 C 1.5379 2.9122 0.0 0
M  V30 9 O 0.0000 2.9929 0.0 0
M  V30 10 O 2.2370 1.5400 0.0 0
M  V30 11 O 6.1721 2.5521 0.0 0
M  V30 12 C 0.9861 6.9332 0.0 0
M  V30 13 C 0.4526 4.9424 0.0 0
M  V30 14 C 4.3131 5.7720 0.0 0 CFG=2
M  V30 15 N 3.9146 4.2845 0.0 0
M  V30 16 C 5.8006 5.3734 0.0 0 CFG=2
M  V30 17 S 3.0215 6.6107 0.0 0
M  V30 18 C 2.3767 4.2038 0.0 0 CFG=1
M  V30 19 C 5.4021 3.8858 0.0 0
M  V30 20 C 1.8248 5.6415 0.0 0
M  V30 21 C 11.1354 5.3734 0.0 0
M  V30 22 C 12.5424 5.9997 0.0 0
M  V30 23 C 11.2965 3.8417 0.0 0
M  V30 24 C 13.5728 4.8554 0.0 0
M  V30 25 S 12.8028 3.5215 0.0 0
M  V30 26 H 4.9395 7.1788 0.0 0
M  V30 27 Na 6.7864 0.0000 0.0 0 VAL=-1
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 16 1 CFG=3
M  V30 3 1 2 3
M  V30 4 2 2 4
M  V30 5 1 3 5
M  V30 6 1 3 21
M  V30 7 1 5 6
M  V30 8 2 5 7
M  V30 9 1 8 9
M  V30 10 2 8 10
M  V30 11 1 18 8 CFG=1
M  V30 12 2 11 19
M  V30 13 1 12 20
M  V30 14 1 13 20
M  V30 15 1 14 15
M  V30 16 1 14 16
M  V30 17 1 14 17
M  V30 18 1 14 26 CFG=1
M  V30 19 1 15 18
M  V30 20 1 15 19
M  V30 21 1 16 19
M  V30 22 1 17 20
M  V30 23 1 18 20
M  V30 24 1 21 22
M  V30 25 2 21 23
M  V30 26 2 22 24
M  V30 27 1 23 25
M  V30 28 1 24 25
M  V30 END BOND
M  V30 BEGIN COLLECTION
M  V30 MDLV30/STEABS ATOMS=(3 14 16 18)
M  V30 END COLLECTION
M  V30 END CTAB
M  END
> <cas.rn>
4697-14-7

> <cas.index.name>
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[2-carboxy-2-(3-thienyl)acetyl]amino]-3,3-dimethyl-7-oxo-, sodium salt (1:2), (2S,5R,6R)-

> <molecular.formula>
C15H16N2O6S2.2Na

> <molecular.weight>
430.41

$$$$
