ID: 50380
SMILES:C1(C)C2=C(C(C)(C)Oc3cc(CCCCC)c(C(=O)O)c(O)c32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.531
InChIKey:VEVSJBMUAKTWOH-UHFFFAOYSA-N
ID: 50381
SMILES:C=C(C)C1C(c2c(O)cc(CCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 50382
SMILES:C12CCC(C)C3(C(=O)C=C1c1c(O)cc(CCC)cc1O2)OC(C)(C)C3CCC=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: Not available
InChIKey:DMGMPDBOIMTLLX-UHFFFAOYSA-N
ID: 50383
SMILES:c1(C)cc(O)c2c(c1)OC(CO)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.796
InChIKey:RARKGHFYSJYWAF-UHFFFAOYSA-N
ID: 50384
SMILES:c1c(O)c(CC=C(C)CCC=C(C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 50385
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 50386
SMILES:CC1(C)Oc2c(c(O)c(OC(=O)C(=CC)C)c(C=O)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -16.162
InChIKey:CSGFXMOMWLYYIW-UHFFFAOYSA-N
ID: 50387
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 50388
SMILES:CCCCCc1cc2c(c(OC)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.239
InChIKey:UZKGLBDVRIILHT-UHFFFAOYSA-N
ID: 50389
SMILES:COc1cc(C2C=C(C)CCC2C(=C)C)c(OC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.814
InChIKey:OFJSDHLGLZNWGY-UHFFFAOYSA-N
ID: 50390
SMILES:CC(C)=CCCC1(C)OC1Cc1c(O)cc(CCCCC)c(C(O)=O)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.05
InChIKey:XRQGOISNAXRYET-UHFFFAOYSA-N
ID: 50391
SMILES:C12c3c(cc(CCCCC)cc3O)C=C(C)C1CC(C)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -14.785
InChIKey:NMBZLMXGCZUEJG-UHFFFAOYSA-N
ID: 50392
SMILES:O=C(CC(C)C)OC(C=C(C)C)c1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -14.924
InChIKey:ZQLWHMDXRSJSAN-UHFFFAOYSA-N
ID: 50393
SMILES:c1(O)cc2cc(c1)OC(C)(C)C1CCC(C)=CC1C=C2CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.256
InChIKey:OHCJSGMDWGWVPH-UHFFFAOYSA-N
ID: 50394
SMILES:C1(CO)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.888
InChIKey:PQLHCGPBCSGLBO-UHFFFAOYSA-N
ID: 50395
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 50396
SMILES:c1c(O)c(C2CC(C)=CC(c3cc(CCN(C)C)ccc3OC)C2C(=C)C)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.582
CB1 binding score: -15.415
InChIKey:FNMQDSGSJAVZCV-UHFFFAOYSA-N
ID: 50397
SMILES:C(CCC)Cc1cc(O)c2c(c1O)OC(C)(C)C1CC(=O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.019
InChIKey:ACTXTTFTOPDNJL-UHFFFAOYSA-N
ID: 50398
SMILES:C1(COC(CC(O)=O)=O)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.523
CB1 binding score: -15.091
InChIKey:STUIHWFMGRGTCQ-UHFFFAOYSA-N
ID: 50399
SMILES:c1(-c2c(O)cc(CCCC)cc2)cc(C(O)CC)c(O)c(CC2(C)C(C)CCC3(C)C2CCC=C3C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.755
CB1 binding score: -13.026
InChIKey:AWFDOGRNYLXGSR-UHFFFAOYSA-N
ID: 50400
SMILES:Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)-c2cc(OC)cc(C)c2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -13.111
InChIKey:CPQMOTZVMUUXTM-UHFFFAOYSA-N