ID: 59977
SMILES:C1C(=O)C(CO)=CC2C1C(C)(C)Oc1cc(CCCCC)c(C(OC)=O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -16.502
InChIKey:LPEHLUYZKXCIBF-UHFFFAOYSA-N
ID: 59978
SMILES:C1C(C(=C)C)C(c2c(O)c(CC=C(C)CCC=C(C)C)c(CCCCC)cc2O)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -16.607
InChIKey:UIZMJGZKGFCXOE-UHFFFAOYSA-N
ID: 59979
SMILES:O(C(COc1c2c(cc(C)c1)OC(C)(C)C1CC=C(C)C(C1)O2)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -16.113
InChIKey:WAPFJLPYVBZTND-UHFFFAOYSA-N
ID: 59980
SMILES:C(OCC(=C)c1c(OC(C)=O)cc(C)c2c1OC(C)(C)C1C2C=C(C)CC1)(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -13.773
InChIKey:QYKBTMXSNKWCCY-UHFFFAOYSA-N
ID: 59981
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 59982
SMILES:C(CCCC)CCCCCCCc1cc2c(c(OC)c1)CC1C2(C)CCCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.702
CB1 binding score: -16.219
InChIKey:JZCGYWINTLBHDV-UHFFFAOYSA-N
ID: 59983
SMILES:CC1(C)C2C1C1C(C)(CC2)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.513
InChIKey:AZIKMVNCPVVUFJ-UHFFFAOYSA-N
ID: 59984
SMILES:Oc1cc(CCC(O)(C)CCC=C(CC2CC(C)C(=O)O2)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.418
InChIKey:PFTZHPNLGDDDIP-UHFFFAOYSA-N
ID: 59985
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 59986
SMILES:CC1C(=O)C2C(C(C)(C)Oc3c(O)c(OC)cc(CCCCC)c32)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -12.847
InChIKey:XTIOVIUOCRGWFE-UHFFFAOYSA-N
ID: 59987
SMILES:C1(CO)[CH]CC(CO)C2CCC(C)C3(C)C(=C2c2c(O)cc(CCCCC)cc2O3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 427.605
CB1 binding score: -14.248
InChIKey:SRUFVDHSSKMCSP-UHFFFAOYSA-N
ID: 59988
SMILES:CC(=C)C1C2c3c(cc(O)c(C(=O)CC(C)C)c3O)OC(C)(C)C2CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -18.906
InChIKey:VHSPVTGIKAERRT-UHFFFAOYSA-N
ID: 59989
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C(=O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.277
InChIKey:YXIXRVQIVIMNBH-UHFFFAOYSA-N
ID: 59990
SMILES:C1CC(Cl)C(C)(C)Oc2cc(CCCCC)cc(Br)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 359.735
CB1 binding score: -15.442
InChIKey:KZUZFSHMRWSZHM-UHFFFAOYSA-N
ID: 59991
SMILES:C(=C(C)CC)CCc1c2ccoc2cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -12.209
InChIKey:DJIMTKZISWCESL-UHFFFAOYSA-N
ID: 59992
SMILES:C1(=O)C2(Oc3c(c(O)cc(CCCCCC)c3)C2O)CC(O)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.321
InChIKey:ARBIESVEESNANW-UHFFFAOYSA-N
ID: 59993
SMILES:C1(C)CC(c2c(O)cc(CCCCC)cc2O)C(C(O)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -17.898
InChIKey:UTLOHIYXFFDSOJ-UHFFFAOYSA-N
ID: 59994
SMILES:C1c2c(cc(CCCCC)cc2O)OC(C)(C)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 59995
SMILES:C(CCCC1Oc2cc(CCC)cc(O)c2C1O)(CCC=C(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.033
InChIKey:BYCZPCOGCYDRDM-UHFFFAOYSA-N
ID: 59996
SMILES:OC(=O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 59997
SMILES:O=Cc1c(C=O)c(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -16.835
InChIKey:HEFOVUYYVFDINY-UHFFFAOYSA-N