ID: 92401
SMILES:C1(C)(C)C2CC(O)C(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 92402
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 92403
SMILES:C12(C)CC(c3c(O)cc(CCCCCO)cc3O1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.472
InChIKey:IFUJGYRFUHHAKN-UHFFFAOYSA-N
ID: 92404
SMILES:C(=C(C)COC(C)=O)CC1(C)C23C=CC(O)CC1(Oc1ccc(CCCCC)cc1O2)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.552
CB1 binding score: -12.999
InChIKey:FVNZYHQVKAITBG-UHFFFAOYSA-N
ID: 92405
SMILES:CC(=CCc1cc(O)cc(C)c1O)CCC=C(C(=O)CC1C(C)(C)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.519
InChIKey:MSYMFUPSWZIXCT-UHFFFAOYSA-N
ID: 92406
SMILES:O(CC)C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.956
InChIKey:GDTZIABCOOKJHI-UHFFFAOYSA-N
ID: 92407
SMILES:O=C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C(O)C(O)(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -19.422
InChIKey:XKBNQMJGFZVAGZ-UHFFFAOYSA-N
ID: 92408
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 92409
SMILES:C12C(C)C=C(C#CC(C)(C)OO)CC1c1c(O)ccc(O)c1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -15.574
InChIKey:QCLJCDTZRBDCQB-UHFFFAOYSA-N
ID: 92410
SMILES:C=C(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 92411
SMILES:C(CCCC)c1cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.511
InChIKey:FJNYRBFCDFVKTA-UHFFFAOYSA-N
ID: 92412
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C2=CCC3C(C)(CCCC3(C)C)C2OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -13.927
InChIKey:IJANAPDZHOCILT-UHFFFAOYSA-N
ID: 92413
SMILES:OC(=O)C(C)=CCCC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -17.882
InChIKey:FGBSGKFPDIQJPK-UHFFFAOYSA-N
ID: 92414
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)C(=O)CC21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.545
InChIKey:VGDFQPVJQSVRQE-UHFFFAOYSA-N
ID: 92415
SMILES:C1(C)=CC2c3c(cc(CCC)cc3O)OC(C)(C)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -18.142
InChIKey:SZPHYTJHUNYTBP-UHFFFAOYSA-N
ID: 92416
SMILES:COc1cc(C2C=C(C)CCC2C(=C)C)c(O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.407
InChIKey:QMFTYLCWBOBNGL-UHFFFAOYSA-N
ID: 92417
SMILES:CC(=CCCC(=C)C1Oc2c(cc(CCCCC)cc2O)CC1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.123
InChIKey:CREKGPRQWCSWJS-UHFFFAOYSA-N
ID: 92418
SMILES:c1(O)cc2c(c(C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.472
InChIKey:MRMJKDJYMLWPGM-UHFFFAOYSA-N
ID: 92419
SMILES:c1(CCCCC)c(C(=O)O)c(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 92420
SMILES:O=C1N(CC(C)C)C2=C3CC(=C(C)C)C(=O)CC3(C)CCC2(O)OC1C1c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 537.697
CB1 binding score: -14.335
InChIKey:XIRNLRDPDNGBNX-UHFFFAOYSA-N
ID: 92421
SMILES:C=C(C1CC=C1C)C(=O)CC(=CCc1c(OC)c(C)cc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -15.823
InChIKey:YSHVZMQFLMJAJF-UHFFFAOYSA-N