ID: 53299
SMILES:CC1(C)C(c2c(O)ccc(CCCCCC)c2)CC(=C)CCC1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.552
InChIKey:ZMFPMIYQDUWSRV-UHFFFAOYSA-N
ID: 53300
SMILES:CC1CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.202
InChIKey:MFJIOMVTDYWLOI-UHFFFAOYSA-N
ID: 53301
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.58
InChIKey:YFGSHSIDDGHTQR-UHFFFAOYSA-N
ID: 53302
SMILES:Oc1c(C(=O)CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.254
InChIKey:OLLFQXZPMRKMFO-UHFFFAOYSA-N
ID: 53303
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.975
InChIKey:DHXIVHTVASKKFZ-UHFFFAOYSA-N
ID: 53304
SMILES:CCC(C=C(C)C)Cc1cc2c(c(O)c1)CC=C(CCC=C(C)C)C(O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -13.496
InChIKey:NXAWIQHFCCOKQQ-UHFFFAOYSA-N
ID: 53305
SMILES:CC1(C)Oc2c(cc(C)c(CCC(C)C3CCC(C)=CC3)c2)C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -15.479
InChIKey:UZVNHIBFFYKOBD-UHFFFAOYSA-N
ID: 53306
SMILES:O(C)c1c(O)c(C2C(C(=C)C)CC(Cl)C(C)=C2)c(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.832
CB1 binding score: -15.625
InChIKey:LVXZVDZYEVCRBY-UHFFFAOYSA-N
ID: 53307
SMILES:C1C2(C)C=C3C(=O)CC(CO)(O3)C2c2c(O)cc(CCCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -14.041
InChIKey:PGWKQPMNCTUSQP-UHFFFAOYSA-N
ID: 53308
SMILES:C(Oc1c2c(ccc1O)OC(CCC=C(C)C)(C)C1CCC(C)=CC12)(C)=CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -12.364
InChIKey:ODFJSXONBSMKQV-UHFFFAOYSA-N
ID: 53309
SMILES:C(c1cc(O)c(C2Cc3c(cc(O)cc3)OC2(C)C)c(OC)c1)CCCCO
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -17.792
InChIKey:DRSWTAIJOXMBIO-UHFFFAOYSA-N
ID: 53310
SMILES:C(C)CCCCc1cc2c(cc1)C=CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.378
CB1 binding score: -16.502
InChIKey:QLSCVKTWUYIYNI-UHFFFAOYSA-N
ID: 53311
SMILES:CC1=CC(c2c(O)cc(O)c(Br)c2CCCCC)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.365
CB1 binding score: -15.929
InChIKey:TWHMAUKEICRPFL-UHFFFAOYSA-N
ID: 53312
SMILES:c1(O)c2c(cc(O)c1)OC(C)(C)C1=CCC(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -15.563
InChIKey:VSPVQMJWCKKMJZ-UHFFFAOYSA-N
ID: 53313
SMILES:CC(c1c2c(c(=O)cc(CCCCC)c1)OC(C)(C)C(O)C2)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.929
InChIKey:QZQMFUBXNITDTL-UHFFFAOYSA-N
ID: 53314
SMILES:C1(O)C2(c3c(cc(CCCCC)cc3O)OC1(C)C)OC(C)(C)C1C2C=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.555
InChIKey:FMHBUOQIWZRROV-UHFFFAOYSA-N
ID: 53315
SMILES:C(CCCC)Cc1cc(O)cc2c1C1C(C(C)(CC)C2CCCO)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -13.888
InChIKey:TWOMGQFIBYCXMQ-UHFFFAOYSA-N
ID: 53316
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 53317
SMILES:Oc1c2c(c(O)c(-c3cc(O)ccc3)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.43
CB1 binding score: -15.929
InChIKey:UACMBODFMGFDPA-UHFFFAOYSA-N
ID: 53318
SMILES:O(CCCCCC)c1c2c(cc(C(C)(C)CCCCCC)c2)C2C(CCC(C)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.739
CB1 binding score: -12.626
InChIKey:BLRWFCLEDLHUPR-UHFFFAOYSA-N
ID: 53319
SMILES:C(C(C)=CCc1c(O)cc(C)cc1O)CCC(C(=O)C=CC(O)(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.42
InChIKey:ACAZWHNFEADIRD-UHFFFAOYSA-N