ID: 53446
SMILES:Oc1c2c(cc(C(C)(C=C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.241
InChIKey:GABCRGOINCCKDV-UHFFFAOYSA-N
ID: 53447
SMILES:C(CC(=CCCC(C)=CCOc1cc(O)cc(CCCCC)c1)C)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.832
InChIKey:BNWJZHOKQJYRLP-UHFFFAOYSA-N
ID: 53448
SMILES:C1(C)C2C(C)(C(=O)C3OC32C(C)=C)CC2c3c(O)cc(CCCCC)cc3OC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -14.037
InChIKey:VHNGHUOKQFYCOE-UHFFFAOYSA-N
ID: 53449
SMILES:CC1(C)OC2(C(C)=C)CC(OC(=O)C)C(C)=CC1c1c(cc(CCCCC)cc1OC(C)=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -16.732
InChIKey:QGIDINJFEULJJV-UHFFFAOYSA-N
ID: 53450
SMILES:c12cc(CCCCC)cc(O)c1C1(O)C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.313
InChIKey:XIIAOXXFRJHRGJ-UHFFFAOYSA-N
ID: 53451
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 53452
SMILES:C1(C)=CC2(C)CCC1c1c(O)cc(CCCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.665
InChIKey:ZQHYETXWVMPAAB-UHFFFAOYSA-N
ID: 53453
SMILES:C(C)(C12C=CC3(OO1)c1c(cc(CCCCC)cc1O)OC3(C)CC2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.255
InChIKey:KXHCJDMCUUANBK-UHFFFAOYSA-N
ID: 53454
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 53455
SMILES:C1=CC(C)(CCC(O)C(=C)C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.337
InChIKey:IDJFUDPWCZNLTI-UHFFFAOYSA-N
ID: 53456
SMILES:CCc1ccc2c(c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 252.357
CB1 binding score: -17.505
InChIKey:YCHYBFZWYJWIEC-UHFFFAOYSA-N
ID: 53457
SMILES:C1CCC2=C(C(O)CC2C)C(C)(C)Oc2cc(CCCCC)c(O)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.389
InChIKey:ABBYENMHXSQONQ-UHFFFAOYSA-N
ID: 53458
SMILES:OCCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 53459
SMILES:CC(C)=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 53460
SMILES:c1(O)cc2c(c3c1C(=O)C1=C(OC(C)(C)C4C1C=C(C)CCC4C(C)=C)C3N)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 435.564
CB1 binding score: Not available
InChIKey:KCVMVXIHXLSHLY-UHFFFAOYSA-N
ID: 53461
SMILES:C(CCC=C(C)C)(CCCC(=CCc1c(O)c(C)cc(O)c1)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.162
InChIKey:GVVUQQWWMGBFAL-UHFFFAOYSA-N
ID: 53462
SMILES:C1(C)=CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 53463
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 53464
SMILES:CC1(C)CCCC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.528
InChIKey:RUNFDTKOHGWARR-UHFFFAOYSA-N
ID: 53465
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 53466
SMILES:CCCCCCc1c(O)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.181
InChIKey:QEEVXBLBSIZXSH-UHFFFAOYSA-N