ID: 66592
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(O)(C)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.929
InChIKey:FDMMGVFNVWWELU-UHFFFAOYSA-N
ID: 66593
SMILES:c1c2c(c(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N
ID: 66594
SMILES:C(=CCc1c(O)ccc2c1OC(C)(C)C1CCC(C)=CC12)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.344
InChIKey:QWDRQWJIEFPPBL-UHFFFAOYSA-N
ID: 66595
SMILES:C1C(C)=C(CC=C(C)C)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.108
InChIKey:UVKBMFJUABVDRV-UHFFFAOYSA-N
ID: 66596
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 66597
SMILES:Oc1cc(CC=C(C)C)c(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 66598
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CC(O)(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.371
InChIKey:HTMXPSLDJAFLMN-UHFFFAOYSA-N
ID: 66599
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 66600
SMILES:C(Cc1cc(O)cc(CC=C(C)C)c1)CC(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -15.471
InChIKey:WVEZGSAQJPNUKZ-UHFFFAOYSA-N
ID: 66601
SMILES:c12c(c(CCCC)cc(O)c1)OC(C(CCC=C(CCC=C(C)C)C)(C)O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.242
InChIKey:OUBGHOBRIBAERN-UHFFFAOYSA-N
ID: 66602
SMILES:CC1(C)Oc2cc(CCCCC)c(C(O)=O)c(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 66603
SMILES:C(CCC)CCCCOC(Oc1cc2c(c(C)c1)OC13CCC(C(C)(C)O1)CC2=CC(=O)O3)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.578
CB1 binding score: -14.65
InChIKey:ZUUAOVCQZNBNAK-UHFFFAOYSA-N
ID: 66604
SMILES:C(CCC)Cc1ccc2c(c1O)C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.672
InChIKey:LLQSTYJXBRCIEX-UHFFFAOYSA-N
ID: 66605
SMILES:c1(C)cc(O)c(O)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.326
InChIKey:TWSMWNXWNZRZTM-UHFFFAOYSA-N
ID: 66606
SMILES:c1(OC)cc(C(C)=O)c(O)c(=O)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -14.041
InChIKey:ZNGCAYXPASPJFL-UHFFFAOYSA-N
ID: 66607
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(OC)cc(C(CC)OC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.128
InChIKey:VFAZXKYOPWJEGC-UHFFFAOYSA-N
ID: 66608
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C3C1CC(C)CC2C(C)=CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -12.836
InChIKey:NZRFVAIZLMBKJA-UHFFFAOYSA-N
ID: 66609
SMILES:c1(C)c2c(cc(CCCCC)c1)OC(C)(C)C1C2(O)C(C)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -11.812
InChIKey:NGEGQMPDUIIOBC-UHFFFAOYSA-N
ID: 66610
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 66611
SMILES:C(c1cc(O)c2c3c1OC1(C)CC3C(CC1)C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.348
InChIKey:DNOFGFXTVAPHAW-UHFFFAOYSA-N
ID: 66612
SMILES:C1CC(C)C(Cl)C2C(C)(C)Oc3cc(C)cc(c31)C(=O)C(C)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.914
CB1 binding score: -15.983
InChIKey:PLTUXVOMADQRFH-UHFFFAOYSA-N