ID: 67516
SMILES:COc1cc2c(c(C(=O)CC(C)C)c1)OC(C)(C)C1CCC(C(O)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -14.097
InChIKey:FSPNDJGAIGKJKA-UHFFFAOYSA-N
ID: 67517
SMILES:c1(O)c(C(C(C)CC)=O)c2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -18.023
InChIKey:KVRAURLFWJOVQT-UHFFFAOYSA-N
ID: 67518
SMILES:COc1cc(CCCCC)cc(O)c1C1=C(C)C(=O)C2(O)CC(C)(CC=CC(C)(C)OO)OC2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.62
CB1 binding score: -15.791
InChIKey:DVPVBYHOSKIJEP-UHFFFAOYSA-N
ID: 67519
SMILES:C(CCC(C)=CCc1c(O)cc(CCCCCO)c(C(=O)O)c1)C(C)(O)C#CC1=C(C)CC(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.632
CB1 binding score: -13.069
InChIKey:GROKKUABRYYERO-UHFFFAOYSA-N
ID: 67520
SMILES:c1c(O)c(CC=C(CCC=C(C)C)C)c(O)cc1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.27
InChIKey:PBVXSNIWCHRXCN-UHFFFAOYSA-N
ID: 67521
SMILES:O=C(c1c(CCCCC)cc2c(c1O)C1CC(C)=CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.038
InChIKey:PRECLYBTLGEJFE-UHFFFAOYSA-N
ID: 67522
SMILES:C(=C(C)C)CCC(C)(O)C=CCC1(C)Oc2c(c(O)cc(CCCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.111
InChIKey:FHKFNMZQZTWTMC-UHFFFAOYSA-N
ID: 67523
SMILES:CC1(C)C2CCC(COC(C)=O)=CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.188
InChIKey:QGWRHEULNGSOKR-UHFFFAOYSA-N
ID: 67524
SMILES:C12C(C)(CCC1C(CC(C=C(C)C)=O)C)C(COc1cc(CCc3ccccc3)cc(OC)c1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -14.471
InChIKey:OOPXQMQHCMKQCT-UHFFFAOYSA-N
ID: 67525
SMILES:c1(C(OC)=O)c(CCCCC)cc2c3c1OC(C)(C)C1CCC(C)(C21)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.83
InChIKey:ITRJDUIAQLFYJO-UHFFFAOYSA-N
ID: 67526
SMILES:Oc1c(C2C(C(C)=C)C(c3cc(CCCCC)cc(OC)c3O)CC(C)=C2)cc(CC=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.658
CB1 binding score: -11.718
InChIKey:AMEQIQUMXIILEY-UHFFFAOYSA-N
ID: 67527
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 67528
SMILES:O(c1c2c(c(O)c(CCCO)c1)C1CC(C)C(O)C(O)C1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.454
CB1 binding score: -12.153
InChIKey:PSRNBBXZLFGPGU-UHFFFAOYSA-N
ID: 67529
SMILES:CC(=CC1CC(C)=CCC1c1c(O)cc(CCCCCCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -14.197
InChIKey:WBVDGJMXBRTHQT-UHFFFAOYSA-N
ID: 67530
SMILES:C(=O)(OC)c1ccc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -18.509
InChIKey:YXRXDJDIHUYQIC-UHFFFAOYSA-N
ID: 67531
SMILES:C(C1=CCC2(C)CC1c1c(cc(CCCCC)cc1O)O2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.972
InChIKey:ZMMDPERLLILPJD-UHFFFAOYSA-N
ID: 67532
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)(CCCCCCCCCc1c2c(ccc1)cccc2C)OC(=O)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 640.949
CB1 binding score: -14.167
InChIKey:AYGQWPXNULEWMH-UHFFFAOYSA-N
ID: 67533
SMILES:CC(O)(C(O)CO)C(c1cc2c(c(O)c1)C1C(O2)C(C)(C)OC(C)(C)C=C1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.464
CB1 binding score: -15.944
InChIKey:ZOSYIDHESWDHJQ-UHFFFAOYSA-N
ID: 67534
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)C(O)CC1C(C)(C)O2)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.779
InChIKey:NBDWQRPGOPBQHG-UHFFFAOYSA-N
ID: 67535
SMILES:C1(CC(C)C=O)=C(C)C2C(C(C)CC2)C2C1C(C)(C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -15.127
InChIKey:MLYREMLZCQVILJ-UHFFFAOYSA-N
ID: 67536
SMILES:C12(O)c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.751
InChIKey:UOSWLQIIJRKKSU-UHFFFAOYSA-N