ID: 91372
SMILES:C(=Cc1c(CCCCC)cc2c(c1O)C1C=C(CO)C(O)CC1C(C)(C)O2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.358
InChIKey:VBHCJNRKILFFGD-UHFFFAOYSA-N
ID: 91373
SMILES:C1C(C)(O)C(C)C2C(OC(=O)CCCCC)C(C)=CC(c3c(O)cc(CCC)cc3O)C2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -15.139
InChIKey:XAGTWCBSLMHRGS-UHFFFAOYSA-N
ID: 91374
SMILES:Oc1cc(C(C)(CCCCC)O)cc(CC=C(C)CCC=C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -14.4
InChIKey:QCKPITSAKDLSCE-UHFFFAOYSA-N
ID: 91375
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 91376
SMILES:c1(CC(O)C(C)(O)C)ccc(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.251
InChIKey:ACSJVVSRQBIGCB-UHFFFAOYSA-N
ID: 91377
SMILES:C12C(=O)OC(C(C)(C)Oc3cc(CCCCC)cc(OC)c3)CC1(C)C(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -15.813
InChIKey:KIOZQEFFIWBAPS-UHFFFAOYSA-N
ID: 91378
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C(C(=O)C(C)CC)O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -15.116
InChIKey:SKTBMRDMAXDVRZ-UHFFFAOYSA-N
ID: 91379
SMILES:CC1=CC(c2ccc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 91380
SMILES:OCCc1ncc2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 273.376
CB1 binding score: -16.099
InChIKey:GFNSIHJHWKVNKB-UHFFFAOYSA-N
ID: 91381
SMILES:C(C(c1c2c(c(O)c(CC=C(CCC=C(C)C)C)c1O)OC(C)(C)C1C2C=C(C)CC1)C)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.771
CB1 binding score: -14.041
InChIKey:ZKQWRISJNIPGEI-UHFFFAOYSA-N
ID: 91382
SMILES:c1(C(=O)O)cc2c(c(O)c1)C1C(CC2)C(C)(C)Oc2c1ccc(O)c2C(CCC=C(C)C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -15.929
InChIKey:BEEPIMAMDUWLCP-UHFFFAOYSA-N
ID: 91383
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C(CCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.658
CB1 binding score: -15.192
InChIKey:HPYQGSJDQYUSOY-UHFFFAOYSA-N
ID: 91384
SMILES:OC12C(C(C)(C)Oc3c1c(OC)cc(CCCCC)c3)C1C(O)C3=C(C(O)CC(=O)C3(C)C)C3(C)C(O)(CC21O)C(C)CO3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 614.776
CB1 binding score: -11.37
InChIKey:AFVDLHGYFLCHFD-UHFFFAOYSA-N
ID: 91385
SMILES:C(=C)(C)C1CC2C(C)(C)Oc3cc(CCCC)ccc3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -14.385
InChIKey:GZZLJKITTRBNBT-UHFFFAOYSA-N
ID: 91386
SMILES:Oc1c2c(c(O)cc1)C1C(O)C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -17.454
InChIKey:MAVOMZLHFUEPTE-UHFFFAOYSA-N
ID: 91387
SMILES:C12CCC3(CO)OC3CC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.16
InChIKey:MFHJWAXHQYCUQP-UHFFFAOYSA-N
ID: 91388
SMILES:C1C(C)(C)C2C(C)(CC1)Oc1c(c(O)cc(CCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 302.458
CB1 binding score: -17.684
InChIKey:SQNFBZBGPYOMLU-UHFFFAOYSA-N
ID: 91389
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.042
InChIKey:FNFYNDHHRPRLKW-UHFFFAOYSA-N
ID: 91390
SMILES:C(CCCC1(C)Oc2c(cc(O)cc2C)CC1)c1cc(O)ccc1C(C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.208
InChIKey:UUSMFERWJCLPQS-UHFFFAOYSA-N
ID: 91391
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)(O2)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.234
InChIKey:UFVCELAHSNOZDY-UHFFFAOYSA-N
ID: 91392
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(CC1)C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.693
InChIKey:GAFDRGDJQPHADJ-UHFFFAOYSA-N