ID: 90763
SMILES:O=S(=O)(O)Oc1c(CCCCC)cc2c(c1O)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.532
CB1 binding score: -15.67
InChIKey:AABLNPRRGIGKBW-UHFFFAOYSA-N
ID: 90764
SMILES:COc1cc(CCc2ccccc2)cc(O)c1CC=C(C)CCC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -18.113
InChIKey:BBNHWNWKWILISB-UHFFFAOYSA-N
ID: 90765
SMILES:C(CCC)c1cc(OC)c(CC(=O)C(=CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.879
InChIKey:WQHKQJADMXYLFW-UHFFFAOYSA-N
ID: 90766
SMILES:C1C2C3C(C)(C)C3CCC2(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.411
InChIKey:VEUPZPQHTGFJMN-UHFFFAOYSA-N
ID: 90767
SMILES:c1(C(C(C)=CC)=O)ccc(O)c2c1OC(C)(C)C1CCC(=C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -12.77
InChIKey:IBSRRQIKAKMUCM-UHFFFAOYSA-N
ID: 90768
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(O)ccc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.467
InChIKey:TVERKJMGSVKUPT-UHFFFAOYSA-N
ID: 90769
SMILES:C1C2C(C)(C)Oc3c(cccc3)C2C=C(C(C=CC(=O)C)O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -15.912
InChIKey:GEVNBDJFOGGYLZ-UHFFFAOYSA-N
ID: 90770
SMILES:C1(CCC=C(C)C)=CC(c2cc(CC(C)C)ccc2O)CC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -17.291
InChIKey:NQCPKCWKJULTCI-UHFFFAOYSA-N
ID: 90771
SMILES:C12C(C)(O)CCC3C1C(C)(C(=O)O)Oc1cc(CCCCC)cc4c1C(C)(CCC4C(C)(C)O3)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -15.984
InChIKey:ZCLMVJUXCATYKG-UHFFFAOYSA-N
ID: 90772
SMILES:O1C2(C(C)C)C3C(C1)c1c(cc(CCCCC)cc1O)OC3(C)C(O)C(=O)C2=C(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -17.601
InChIKey:RONAONFGIXGUTJ-UHFFFAOYSA-N
ID: 90773
SMILES:CC1CC2C(C(C)(C)Oc3c2c(O)c(Cl)c(C(CC)C)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.903
CB1 binding score: -13.544
InChIKey:DBOPEUGCCPAKJW-UHFFFAOYSA-N
ID: 90774
SMILES:C1(C=CC(C)OC(=O)C)(CO)OCC2c3c(O)cc(CCCCC)cc3OC2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -14.429
InChIKey:OMKRBWIHUSAOLU-UHFFFAOYSA-N
ID: 90775
SMILES:CC1=CC2C(C(C)(C)Oc3c(C(=O)C(C)C)c(O)cc4c3C2(C)CC(O)C(Cl)C4(C)C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 489.052
CB1 binding score: -15.699
InChIKey:OJLABTOYNSGBSU-UHFFFAOYSA-N
ID: 90776
SMILES:CC(C)=CC1C23C(CCC2(C)O3)c2c(cc(CCCCC)cc2O)OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -11.566
InChIKey:BDUXZDUSEGRPGO-UHFFFAOYSA-N
ID: 90777
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 90778
SMILES:C1C2C(O)(C(O)CC1(C)C=C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.434
InChIKey:CIKSYOCWNQYZDF-UHFFFAOYSA-N
ID: 90779
SMILES:CC(C)CCC(c1c(O)cc(CC=C(CCC=C(C)C)C)c(O)c1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.242
InChIKey:LGISQQDMHOOILO-UHFFFAOYSA-N
ID: 90780
SMILES:O(C)c1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.273
InChIKey:QQKRWAQYJVGZFH-UHFFFAOYSA-N
ID: 90781
SMILES:Cc1cc(CCCCC)cc2c1-c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.465
CB1 binding score: -18.16
InChIKey:MFLSNUUVRWUBJF-UHFFFAOYSA-N
ID: 90782
SMILES:c1(CCCCC)cc(OC)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.605
InChIKey:JYFAKXXLWHGXRQ-UHFFFAOYSA-N
ID: 90783
SMILES:CC(OC1(CO)C(O)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -17.253
InChIKey:KRLAVKWUABAGRK-UHFFFAOYSA-N