ID: 54559
SMILES:O(C(c1cc2c(cc1C)OC(C)(C)C1C(=C(C)C(=O)C1=O)O2)CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -14.76
InChIKey:BOFHKXOEGGDQHG-UHFFFAOYSA-N
ID: 54560
SMILES:CC(C)C1CC(=O)C(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.553
InChIKey:RFWFWIPFHZNMBJ-UHFFFAOYSA-N
ID: 54561
SMILES:CC1(C)C2CC=C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 54562
SMILES:CC12OC1CCC1(C)Oc3cc(CCCC)cc(O)c3C1C2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -6.01
InChIKey:BMGLZBBVYBDQMK-UHFFFAOYSA-N
ID: 54563
SMILES:C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(CO)=CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -12.682
InChIKey:ZZPKLCQWTGVIIF-UHFFFAOYSA-N
ID: 54564
SMILES:C1(=O)C2(c3c(OC)cc(CCCCC)cc3O1)C(=C(C)C)CCC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.762
InChIKey:AOHIJLSQDRNPCL-UHFFFAOYSA-N
ID: 54565
SMILES:Oc1cc(CCCCC)cc2c1C1C3(C(O2)O1)C(C)(C)OCC1C2(CCC(c4ccoc4)OC2=O)C31
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.584
CB1 binding score: -12.731
InChIKey:WZMCDVRUFUWJBV-UHFFFAOYSA-N
ID: 54566
SMILES:CC1C2C(c3c(O)cc(CCCCC)cc3O1)OC(C=C(C)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.625
InChIKey:NOQXLHZYVHRTHT-UHFFFAOYSA-N
ID: 54567
SMILES:C1(C)(O)C2C(O)CC(CO)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.455
CB1 binding score: -14.038
InChIKey:IQHMEFLAZDNJHM-UHFFFAOYSA-N
ID: 54568
SMILES:C(O)c1c2cc(c(C)c1)-c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -11.513
InChIKey:NKRLGUWADJDVTE-UHFFFAOYSA-N
ID: 54569
SMILES:c1c(C)c2ccc3c(c2cc1OC)CC(C)C(C)(C)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -16.581
InChIKey:BPFNIZNLQXDDKZ-UHFFFAOYSA-N
ID: 54570
SMILES:CC(C)C1C(c2c(O)cc(CCCCCN(C)C)cc2O)CC(C)=CC1c1cc(C)ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 465.678
CB1 binding score: -15.072
InChIKey:VKPIXICMAAQEME-UHFFFAOYSA-N
ID: 54571
SMILES:C12C(c3c(O)c(O)cc(CCCCC)c3)CCC1C(C)(C)OC2C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.547
InChIKey:FPJNBALASXILOA-UHFFFAOYSA-N
ID: 54572
SMILES:C(c1c(O)c(C(OC)CCCC)cc(Oc2cc(CC=C(C)CCC=C(C)C)c(O)cc2)c1O)C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.845
CB1 binding score: -12.841
InChIKey:KFEGHVCNTNZZKF-UHFFFAOYSA-N
ID: 54573
SMILES:O1CC2C(CCC2=C)C1C1COc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.651
InChIKey:WTWZTVCERAZTIX-UHFFFAOYSA-N
ID: 54574
SMILES:CC1(C)C2C1c1c(O)cc(CCCCC)cc1OC2C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.015
InChIKey:HXLQWJUBJQGMCS-UHFFFAOYSA-N
ID: 54575
SMILES:Oc1c2c(c(C)c(-c3c(O)cccc3)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.458
CB1 binding score: -13.553
InChIKey:KJDYXYUHYYYMMY-UHFFFAOYSA-N
ID: 54576
SMILES:C1(=O)C2=C(C(O)CC2C)C(C)(C)Oc2c(c(O)cc(C)c2)C2CC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -13.627
InChIKey:CAILJXZEJXVXIP-UHFFFAOYSA-N
ID: 54577
SMILES:C(O)C1=CC2C(C(C)(C)Oc3cc(C)ccc32)CC1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.193
InChIKey:UQTDRYKTCQEBHD-UHFFFAOYSA-N
ID: 54578
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 54579
SMILES:C1C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.389
InChIKey:UHEDSPPIFUFKCL-UHFFFAOYSA-N