ID: 41896
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 41897
SMILES:C(C(O)C(c1c(O)c2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)CC)(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.448
CB1 binding score: -17.201
InChIKey:NHSJZHNUULDJTI-UHFFFAOYSA-N
ID: 41898
SMILES:C(Cc1c(O)c(C(O)=O)c(CCCCC)cc1O)=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 41899
SMILES:C1(C)(C)Oc2c(c(O)cc(C)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 41900
SMILES:C1(C)=CC(CC(=CCc2cc(OC)cc(C)c2O)C)C(C(C)(O)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.824
InChIKey:QEMBPXROPLKWOW-UHFFFAOYSA-N
ID: 41901
SMILES:C1(CC(=O)O)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.083
InChIKey:FESRWUKRYVSSSO-UHFFFAOYSA-N
ID: 41902
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 41903
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1O)=Cc1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.524
CB1 binding score: -12.264
InChIKey:NIQJVKVHVXFQEN-UHFFFAOYSA-N
ID: 41904
SMILES:O(C)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.792
InChIKey:VDKAKXBXSAFIMF-UHFFFAOYSA-N
ID: 41905
SMILES:c12c(C=O)c(O)c(O)c(CC=C(C)C)c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.426
InChIKey:MSCVQCIQEKKOTN-UHFFFAOYSA-N
ID: 41906
SMILES:CC1(C)Oc2c(c(O)c(CC=C(C)C)c(O)c2CCCCC)C2CC1CCC1(C)OC1C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -13.893
InChIKey:TZWWPYANRCIOBT-UHFFFAOYSA-N
ID: 41907
SMILES:O(C(C(O)(C)C)c1c2c(c(OC)cc1C)OC(C)(C)C1CCC(C)=CC21)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.032
InChIKey:PXKBTKQGHIHRJM-UHFFFAOYSA-N
ID: 41908
SMILES:c1(O)cc(CCCCC)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 41909
SMILES:O1C(C(CCO)C=O)=C(O)C(CCC(O)=O)C1c1cc2c(c(O)c1)C1C(CC=C(C)C1=O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.544
CB1 binding score: -15.57
InChIKey:UEFRGDGNWQVJTK-UHFFFAOYSA-N
ID: 41910
SMILES:O=C1C(C)=CC2c3c(O)cc(C)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.466
InChIKey:OOSGYAFEZCZRRA-UHFFFAOYSA-N
ID: 41911
SMILES:C(c1ccccc1)c1c(CCCC)cc2c(c1O)OC(C)(C)C1C2C=C(C)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -11.965
InChIKey:FUBVXLVZLCDCQM-UHFFFAOYSA-N
ID: 41912
SMILES:O(CCCC)c1c2c(c(C(=O)C(C)C)cc1)OC(C)(C)C1CCC(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.575
InChIKey:LHOIRGXNKHVGFH-UHFFFAOYSA-N
ID: 41913
SMILES:O1c2cc(CCCC)cc(O)c2C2C3C(C(C)C)CC(O)C1(C)C3C(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -12.736
InChIKey:UPQUYXCWYHZUFW-UHFFFAOYSA-N
ID: 41914
SMILES:CC(C1(O)CCC(C)=CC1c1c(O)cc(CCCCC)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.134
InChIKey:CMALWUYNXYEHMS-UHFFFAOYSA-N
ID: 41915
SMILES:CCCCc1cc(O)c2c3c1OC(C)(CCC=C(C)C)C(O)C3Oc1c(c3c(cc1O)OC(CCC=C(C)CO)(C)C=C3)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 604.784
CB1 binding score: -14.557
InChIKey:GZZOGPIWDCHMCK-UHFFFAOYSA-N
ID: 41916
SMILES:C(O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N