ID: 65248
SMILES:C1(C)(C)Oc2c(c(OC)cc(CCCCCC)c2)C2C1CCC1(C)OC2CCC(C)=CCCC1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.748
CB1 binding score: -15.527
InChIKey:IZCOIAYVXLUSSP-UHFFFAOYSA-N
ID: 65249
SMILES:C(CCCCO)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.994
InChIKey:LMBWGTCVCVGVJC-UHFFFAOYSA-N
ID: 65250
SMILES:O1C(=O)C2(c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC2C(C)(C)O2)C2C1C(=O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.59
CB1 binding score: -16.08
InChIKey:WTGCDCSXPDOXCG-UHFFFAOYSA-N
ID: 65251
SMILES:C(CCCC)CCc1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.209
InChIKey:VPDBCGRUZCACNK-UHFFFAOYSA-N
ID: 65252
SMILES:C(C)C(C(=O)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C(=O)CCC=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -15.526
InChIKey:VDIDAYGJVIKPQQ-UHFFFAOYSA-N
ID: 65253
SMILES:CC1C(=O)OC2CC(C)C3(O)C(c4c(cc(CCCCC)cc4O)O3)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -12.872
InChIKey:WKFFXLDEVJXHOE-UHFFFAOYSA-N
ID: 65254
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 65255
SMILES:C(CC)Cc1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.479
InChIKey:QHFVULIOBFWRAD-UHFFFAOYSA-N
ID: 65256
SMILES:c1c(CCCCCC)c2c(cc1)C1C(CCC1C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -16.125
InChIKey:YFPPLFYDXSYZSP-UHFFFAOYSA-N
ID: 65257
SMILES:c1(CC2C(C)(C)OC(=O)C2)c(C)c(C(OC)=O)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: Not available
InChIKey:LEUKLANXLKBCRA-UHFFFAOYSA-N
ID: 65258
SMILES:c1c(CCO)c(C(=O)O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -13.511
InChIKey:JENCVJXNSDXFGZ-UHFFFAOYSA-N
ID: 65259
SMILES:c1(=O)c(CC=C(C)CCC=C(C)C)ccc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -15.158
InChIKey:ZYVVMIHEYQHNCZ-UHFFFAOYSA-N
ID: 65260
SMILES:C(Cc1cc(O)c(C2C=C(CO)CCC2C(C)C)c(O)c1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.265
InChIKey:UJJTZAQMGBUTCC-UHFFFAOYSA-N
ID: 65261
SMILES:C1(=C(C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.089
InChIKey:MXHIJQHAYHJSTF-UHFFFAOYSA-N
ID: 65262
SMILES:c1(COC2OC(CO)C(O)C(O)C2O)cc(O)c(C2C=C(C)CCC2C(=C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.501
CB1 binding score: -12.731
InChIKey:OONXWNLXHXPOFI-UHFFFAOYSA-N
ID: 65263
SMILES:c1(O)c(=O)c(OC)c(CCCCC)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.19
InChIKey:IVLIABKHVPWICJ-UHFFFAOYSA-N
ID: 65264
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)(O)C1)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -13.57
InChIKey:NXCLIMFPFMGVCB-UHFFFAOYSA-N
ID: 65265
SMILES:c12cc(CCCCC)cc(O)c1C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 65266
SMILES:C(=CCOc1c2c(cc(C(=O)O)c1)OC(C)(C)C1CCC(C)=CC21)C=CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -15.535
InChIKey:AEMQXXQPYYZYDT-UHFFFAOYSA-N
ID: 65267
SMILES:CC1CCC(C(C)C)C(c2c(O)cc(CCCCCO)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -16.585
InChIKey:YIQUWATZLSUWJG-UHFFFAOYSA-N
ID: 65268
SMILES:C1(C)(C)Oc2c(c(O)c(CCCCC)c(C(O)=O)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.491
InChIKey:ZDSCGPKQNSXTPX-UHFFFAOYSA-N